[(2R,3S,4R,5R)-3,4-Dihydroxy-5-(6-Oxo-3H-Purine-1,7-Diium-4-Id-9-Yl)Tetrahydrofuran-2-Yl]Methoxy-Dihydroxy-Sulfido-Phosphonium

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Properties Simple | Detailed

Formula C10H16N4O7PS+
IUPAC Name [(2r,3s,4r,5r)-3,4-dihydroxy-5-(6-oxo-3h-purine-1,7-diium-4-id-9-yl)tetrahydrofuran-2-yl]methoxy-dihydroxy-sulfido-phosphonium
Molecular Mass 367.295 g·mol−1
Heat of Formation -1244.1 ± 16.7 kJ·mol−1
Dipole Moment 14.07 ± 1.08 D
Volume 365.7 Å 3
Surface Area 309.94 Å 2
HOMO Energy -9.11 ± 0.55 eV
LUMO Energy 2.46 ± eV
Point Group Symmetry C1
InChIKey TVRJEQPVPGMQDS-KQYNXXCUSA-P
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